Match z (C4) (t=400 au)
Commits >
Commit af26893c7aa01c4d6db9b9440ccd945f9c92b2ee >
Run spack_intel-2023a_serial_omp >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| -1.325022533299300e+00 | -1.325015210000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 14)